SCHEMBL14743222

SCHEMBL14743222

CCN(C(N)=O)c1cc(C(N)=O)nc(-c2ccc(O)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.45
FPR2 P25090 9/20 0.45
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14743343 0.80 SCN9A (0.59) SCN9AFPR2KDM4E
SCHEMBL14743144 0.75 LMNA (0.56) KDM4EMEN1KMT2A
SCHEMBL19072510 0.68 FPR2 (0.69) SCN9AFPR2
SCHEMBL7575874 0.67 ALDH1A1 (0.47) MEN1KMT2A
SCHEMBL19945965 0.67 FPR2 (0.70) SCN9AFPR2
SCHEMBL14743323 0.67 FPR2 (0.70) SCN9AFPR2
SCHEMBL4829425 0.60 KDM4E (0.60) KDM4EMEN1KMT2A
SCHEMBL195531 0.60 MEN1 (0.68) KDM4EMEN1KMT2A
SCHEMBL21236828 0.59 SCN9A (0.47) SCN9AKDM4EMEN1KMT2A
SCHEMBL27616905 0.59 HSP90AB1 (0.37) KDM4EMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2964639-A1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS Purdue Pharma LP (US) 2016-01-13 EP disclosed
WO-2014135955-A1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2014-09-12 WO disclosed
WO-2013030665-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2013-03-07 WO disclosed